ethyl 2,4-dimethyl-6-[3-methyl-4-[(2R)-2-phenylcyclopropyl]carbonyl-piperazin-1-yl]carbonyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-6-[3-methyl-4-[(2R)-2-phenylcyclopropyl]carbonyl-piperazin-1-yl]carbonyl-pyrimidine-5-carboxylate Openeye Name: ethyl 2,4-dimethyl-6-[3-methyl-4-[(2R)-2-phenylcyclopropanecarbonyl]piperazine-1-carbonyl]pyrimidine-5-carboxylate CAS Name: 2,4-dimethyl-6-[[3-methyl-4-[oxo-[(2R)-2-phenylcyclopropyl]methyl]-1-piperazinyl]-oxomethyl]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-6-[3-methyl-4-[(2R)-2-phenylcyclopropanecarbonyl]piperazine-1-carbonyl]pyrimidine-5-carboxylate Traditional Name: 2,4-dimethyl-6-[3-methyl-4-[(2R)-2-phenylcyclopropanecarbonyl]piperazine-1-carbonyl]pyrimidine-5-carboxylic acid ethyl ester Formula: C25H30N4O4 MolecularWeight: 450.5301

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N=C1C)C)C(=O)N2CCN(C(C2)C)C(=O)C3CC3C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=C1C)C)C(=O)N2CCN(C(C2)C)C(=O)C3C[C@H]3C4=CC=CC=C4

InChI

InChI=1S/C25H30N4O4/c1-5-33-25(32)21-16(3)26-17(4)27-22(21)24(31)28-11-12-29(15(2)14-28)23(30)20-13-19(20)18-9-7-6-8-10-18/h6-10,15,19-20H,5,11-14H2,1-4H3/t15?,19-,20?/m0/s1